⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5083503 | 0.64 | LMNA (0.34) | — | |
| Hydrochloric Acid SCHEMBL8680282 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL8679848 | 0.57 | — | — | |
| Hydrochloric Acid SCHEMBL8679855 | 0.57 | — | — | |
| SCHEMBL25574426 | 0.55 | ESR1 (0.40) | — | |
| SCHEMBL28249284 | 0.55 | HPGD (0.47) | — | |
| SCHEMBL547838 | 0.55 | KCNH2 (0.60) | — | |
| SCHEMBL5821162 | 0.55 | GHSR (0.36) | — | |
| SCHEMBL27466300 | 0.54 | CYP2C19 (0.37) | — | |
| SCHEMBL20204607 | 0.54 | TYR (0.41) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1041084-A1 | SOLID CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME | MARUZEN PETROCHEMICAL CO., LTD. (JP) | 2000-10-04 | — | — | EP | disclosed |